SCHEMBL8097932

SCHEMBL8097932

CCCOc1[c]c(Cl)ncc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.33
RAB9A P51151 4/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
HPGD P15428 3/20 0.33
CSNK2A1 P68400 2/20 0.33
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
MCHR1 Q99705 1/20 0.32
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
LTA4H P09960 1/20 0.31
GRM5 P41594 1/20 0.31
GCGR P47871 2/20 0.30
MAPK14 Q16539 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
PDE5A O76074 1/20 0.30
PDE4A P27815 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8107309 0.85 HPGD (0.39) NPC1SMN1; SMN2HPGDMAPK1KDM4E
SCHEMBL4930687 0.76
SCHEMBL8097969 0.72 LRRK2 (0.33)
SCHEMBL25172614 0.72 KMT2A (0.34) NPC1RAB9ASMN1; SMN2HPGDCSNK2A1
SCHEMBL4917812 0.72 MAPT (0.34) NPC1RAB9ASMN1; SMN2HPGDMAPT
SCHEMBL185541 0.71 KMT2A (0.39) NPC1RAB9ASMN1; SMN2HPGDMAPT
SCHEMBL14844395 0.68
SCHEMBL4253734 0.66 CSNK2A1 (0.34) HPGDCSNK2A1MAPTKDM4EALDH1A1
SCHEMBL7312275 0.65 KMT2A (0.35) NPC1RAB9ASMN1; SMN2HPGDMAPT
SCHEMBL16885185 0.65 NUDT1 (0.37) NPC1RAB9ASMN1; SMN2HPGDCSNK2A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1091100-C N-arylsulfilimine compounds and their use as catalysts for the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 2002-09-18 CN disclosed
US-6114580-A N-arylsulfilimine compounds and their use as catalysts in the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 2000-09-05 US disclosed
EP-0888297-B1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS DOW AGROSCIENCES LLC (US) 2000-08-30 EP disclosed
US-5973148-A N-arylsulfilimine compounds and their use as catalysts in the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 1999-10-26 US disclosed
CN-1216040-A N-arylsulfilimine compounds and their use as catalysts in preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 1999-05-05 CN disclosed
EP-0888297-A1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS Dow AgroSciences LLC (US) 1999-01-07 EP disclosed
WO-1998021178-A1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS DOW AGROSCIENCES LLC (US) 1998-05-22 WO disclosed